SCHEMBL6844884

SCHEMBL6844884

CC1CC=CC(=O)C1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 3/20 0.46
▸ PSEN1 P49768 2/20 0.30
▸ PSEN2 P49810 2/20 0.30
▸ APH1B Q8WW43 2/20 0.30
▸ NCSTN Q92542 2/20 0.30
▸ APH1A Q96BI3 2/20 0.30
▸ PSENEN Q9NZ42 2/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL435682 0.79 ALDH1A1 (0.46) OPRD1PSEN1PSEN2APH1BNCSTN
SCHEMBL7727816 0.75 ALDH1A1 (0.41) OPRD1
SCHEMBL14725632 0.72 — —
SCHEMBL28683041 0.70 — —
SCHEMBL8080611 0.67 ALDH1A1 (0.41) —
SCHEMBL1072882 0.66 — —
SCHEMBL19205899 0.65 TP53 (0.38) OPRD1PSEN1PSEN2APH1BNCSTN
SCHEMBL961594 0.65 CCR2 (0.34) —
SCHEMBL6914864 0.64 POLB (0.43) —
SCHEMBL264855 0.64 POLB (0.43) —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0743574-B1 Migration imaging members XEROX CORP (US) 2000-12-27 — — EP claimed
EP-0743573-B1 Method for obtaining image contrast migration imaging members XEROX CORP (US) 2000-09-06 — — EP claimed
WO-2017063327-A1 NOVEL C-SPIRO-O-GLYCOSIDE COMPOUND INTERMEDIATE AND PREPARATION METHOD THEREFOR 上海应用技术学院 2017-04-20 — — WO disclosed
WO-2011044506-A2 SULPHONE COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2011-04-14 — — WO disclosed
Send feedback